Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6n78_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N ASP 1.A OD1 no hydrogen 2.966 N/A THR 3.A OG1 ASP 1.A OD1 no hydrogen 2.740 N/A THR 3.A OG1 ASP 1.A OD2 no hydrogen 3.568 N/A HIS 4.A N ASP 1.A O no hydrogen 3.199 N/A PHE 5.A N ILE 73.A O no hydrogen 2.970 N/A GLU 6.A N TYR 29.A OH no hydrogen 3.015 N/A ARG 8.A NE GLU 6.A OE2 no hydrogen 3.028 N/A ARG 8.A NH2 GLU 6.A OE2 no hydrogen 2.831 N/A PHE 9.A N GLU 6.A O no hydrogen 3.214 N/A LEU 10.A N LYS 7.A O no hydrogen 3.220 N/A LYS 11.A N ARG 28.A O no hydrogen 2.935 N/A ARG 12.A NE ASP 15.A OD1 no hydrogen 3.287 N/A ARG 12.A NE GLU 25.A OE2 no hydrogen 2.990 N/A ARG 12.A NH2 ASP 15.A OD1 no hydrogen 2.869 N/A ILE 13.A N LEU 26.A O no hydrogen 2.776 N/A ARG 14.A N LEU 26.A O no hydrogen 3.314 N/A LEU 16.A N VAL 24.A O no hydrogen 2.802 N/A GLY 17.A N VAL 24.A O no hydrogen 3.406 N/A GLY 19.A N GLY 22.A O no hydrogen 2.840 N/A HIS 20.A ND1 ASP 165.A OD2 no hydrogen 3.235 N/A LYS 23.A N SER 44.A O.A no hydrogen 2.909 N/A LYS 23.A N SER 44.A O.B no hydrogen 2.906 N/A LYS 23.A NZ ASP 15.A OD1 no hydrogen 3.042 N/A LYS 23.A NZ ASP 15.A OD2 no hydrogen 2.897 N/A LYS 23.A NZ GLU 25.A OE2 no hydrogen 3.181 N/A VAL 24.A N GLY 17.A O no hydrogen 3.018 N/A GLU 25.A N VAL 42.A O no hydrogen 2.960 N/A LEU 26.A N ARG 14.A O no hydrogen 2.738 N/A CYS 27.A N VAL 40.A O no hydrogen 3.030 N/A ARG 28.A N LYS 11.A O no hydrogen 2.889 N/A ARG 28.A NH1 GLY 37.A O no hydrogen 2.777 N/A TYR 29.A N GLU 38.A O no hydrogen 2.911 N/A ASP 30.A N PHE 9.A O no hydrogen 2.879 N/A GLY 33.A N ASP 30.A O no hydrogen 3.085 N/A ASN 35.A N ASP 30.A OD2 no hydrogen 2.809 N/A THR 36.A N ASP 30.A OD1 no hydrogen 3.059 N/A THR 36.A N ASP 34.A OD1 no hydrogen 3.303 N/A THR 36.A OG1 ASP 34.A OD1 no hydrogen 2.672 N/A THR 36.A OG1 ASP 34.A OD2 no hydrogen 3.480 N/A GLY 37.A N ASP 30.A OD1 no hydrogen 2.927 N/A VAL 40.A N CYS 27.A O no hydrogen 2.854 N/A ALA 41.A N MET 81.A O no hydrogen 2.969 N/A VAL 42.A N GLU 25.A O no hydrogen 2.948 N/A LYS 43.A N LEU 79.A O no hydrogen 2.835 N/A LYS 43.A NZ GLU 55.A OE1 no hydrogen 3.570 N/A LYS 43.A NZ GLU 55.A OE2 no hydrogen 2.730 N/A LYS 43.A NZ ASP 146.A OD1 no hydrogen 2.789 N/A LYS 43.A NZ ASP 146.A OD2 no hydrogen 3.441 N/A SER 44.A N.A LYS 23.A O no hydrogen 2.918 N/A SER 44.A N.B LYS 23.A O no hydrogen 2.915 N/A LYS 46.A N PHE 21.A O no hydrogen 2.884 N/A LYS 46.A NZ GLU 18.A OE1 no hydrogen 2.872 N/A LYS 46.A NZ GLY 19.A O no hydrogen 2.803 N/A LYS 46.A NZ HIS 20.A O no hydrogen 3.495 N/A LEU 52.A N HIS 48.A O no hydrogen 3.001 N/A LYS 53.A N ILE 49.A O no hydrogen 3.061 N/A LYS 54.A N ALA 50.A O no hydrogen 3.195 N/A GLU 55.A N ASP 51.A O no hydrogen 2.957 N/A ILE 56.A N LEU 52.A O no hydrogen 2.814 N/A GLU 57.A N LYS 53.A O no hydrogen 3.164 N/A ILE 58.A N LYS 54.A O no hydrogen 3.126 N/A LEU 59.A N GLU 55.A O no hydrogen 3.163 N/A ARG 60.A N ILE 56.A O no hydrogen 2.945 N/A ARG 60.A NE GLU 57.A OE1 no hydrogen 2.913 N/A ARG 60.A NE GLU 57.A OE2 no hydrogen 3.398 N/A ARG 60.A NH2 GLU 57.A OE2 no hydrogen 2.972 N/A ASN 61.A N ILE 58.A O no hydrogen 3.309 N/A ASN 61.A ND2 GLU 57.A O no hydrogen 2.947 N/A ASN 61.A ND2 GLU 57.A OE2 no hydrogen 3.126 N/A LEU 62.A N LEU 59.A O no hydrogen 3.063 N/A TYR 63.A N TYR 118.A OH no hydrogen 3.058 N/A ASN 66.A N HIS 64.A ND1 no hydrogen 3.066 N/A ILE 67.A N HIS 64.A O no hydrogen 3.137 N/A VAL 68.A N ILE 144.A O no hydrogen 2.953 N/A LYS 69.A N GLU 82.A OE2 no hydrogen 3.020 N/A LYS 71.A N ILE 80.A O no hydrogen 2.874 N/A LYS 71.A NZ GLU 38.A OE1 no hydrogen 3.320 N/A LYS 71.A NZ GLU 38.A OE2 no hydrogen 3.148 N/A GLY 72.A N ILE 80.A O no hydrogen 3.075 N/A ILE 73.A N THR 3.A O no hydrogen 3.013 N/A CYS 74.A N LYS 78.A O no hydrogen 3.129 N/A CYS 74.A SG PHE 5.A O no hydrogen 3.556 N/A LYS 78.A N CYS 74.A O no hydrogen 2.911 N/A LYS 78.A NZ SER 44.A OG.B no hydrogen 3.333 N/A LEU 79.A N LYS 43.A O no hydrogen 3.006 N/A ILE 80.A N GLY 72.A O no hydrogen 2.876 N/A MET 81.A N ALA 41.A O no hydrogen 2.903 N/A GLU 82.A N LYS 69.A O no hydrogen 3.034 N/A GLY 87.A N LEU 84.A O no hydrogen 3.222 N/A LEU 89.A N VAL 134.A O no hydrogen 2.855 N/A LYS 90.A NZ CYS 201.A O no hydrogen 2.994 N/A GLU 91.A N SER 88.A O no hydrogen 3.284 N/A TYR 92.A N SER 88.A O no hydrogen 2.972 N/A LEU 93.A N LEU 89.A O no hydrogen 2.915 N/A LYS 95.A N TYR 92.A O no hydrogen 3.316 N/A ASN 96.A N LEU 93.A O no hydrogen 3.152 N/A ASN 96.A ND2 TYR 92.A O no hydrogen 2.790 N/A LYS 99.A N ASN 96.A O no hydrogen 3.021 N/A ILE 100.A N ASN 96.A O no hydrogen 3.226 N/A LYS 103.A NZ LEU 274.A O no hydrogen 3.567 N/A GLN 104.A N ASN 101.A OD1 no hydrogen 3.166 N/A GLN 105.A N ASN 101.A O no hydrogen 3.043 N/A LEU 106.A N LEU 102.A O no hydrogen 2.956 N/A LYS 107.A N LYS 103.A O no hydrogen 3.123 N/A TYR 108.A N GLN 104.A O no hydrogen 2.916 N/A TYR 108.A OH GLU 139.A O no hydrogen 3.128 N/A ALA 109.A N GLN 105.A O no hydrogen 2.976 N/A VAL 110.A N LEU 106.A O no hydrogen 2.981 N/A GLN 111.A N LYS 107.A O no hydrogen 3.070 N/A GLN 111.A NE2 HIS 140.A O no hydrogen 3.059 N/A ILE 112.A N TYR 108.A O no hydrogen 2.967 N/A CYS 113.A N ALA 109.A O no hydrogen 3.086 N/A CYS 113.A SG ALA 109.A O no hydrogen 3.513 N/A LYS 114.A N VAL 110.A O no hydrogen 2.906 N/A GLY 115.A N GLN 111.A O no hydrogen 3.071 N/A MET 116.A N ILE 112.A O no hydrogen 2.893 N/A ASP 117.A N CYS 113.A O no hydrogen 2.835 N/A TYR 118.A N LYS 114.A O no hydrogen 3.119 N/A LEU 119.A N GLY 115.A O no hydrogen 3.177 N/A GLY 120.A N MET 116.A O no hydrogen 2.981 N/A SER 121.A N ASP 117.A O no hydrogen 3.022 N/A SER 121.A OG TYR 118.A O no hydrogen 2.747 N/A ARG 122.A N LEU 119.A O no hydrogen 3.097 N/A GLN 123.A N GLY 120.A O no hydrogen 3.314 N/A GLN 123.A NE2 ILE 153.A O no hydrogen 3.582 N/A VAL 125.A N LYS 151.A O no hydrogen 2.811 N/A HIS 126.A N ASP 186.A OD2 no hydrogen 2.774 N/A HIS 126.A NE2 ASP 146.A O no hydrogen 2.778 N/A ARG 127.A N ASP 186.A OD1 no hydrogen 3.131 N/A ARG 127.A NE LEU 149.A O no hydrogen 2.912 N/A ARG 127.A NH1 LEU 149.A O no hydrogen 3.507 N/A ASP 128.A N HIS 126.A ND1 no hydrogen 3.119 N/A ALA 131.A N GLU 196.A OE1 no hydrogen 2.924 N/A ARG 132.A NH1 ASP 128.A OD2 no hydrogen 3.374 N/A ARG 132.A NH2 ASP 128.A OD1 no hydrogen 2.774 N/A ASN 133.A N ALA 130.A O no hydrogen 3.032 N/A ASN 133.A ND2 ASP 128.A O no hydrogen 2.859 N/A ASN 133.A ND2 ASP 128.A OD2 no hydrogen 3.137 N/A VAL 134.A N ALA 131.A O no hydrogen 3.222 N/A LEU 135.A N LYS 143.A O no hydrogen 2.750 N/A VAL 136.A N GLY 87.A O no hydrogen 2.883 N/A GLU 137.A N GLN 141.A O no hydrogen 2.863 N/A SER 138.A N GLN 141.A O no hydrogen 3.153 N/A HIS 140.A N SER 138.A OG no hydrogen 3.113 N/A GLN 141.A N SER 138.A O no hydrogen 3.181 N/A GLN 141.A NE2 GLU 65.A O no hydrogen 2.921 N/A VAL 142.A N GLN 111.A OE1 no hydrogen 2.887 N/A LYS 143.A N LEU 135.A O no hydrogen 2.876 N/A LYS 143.A NZ GLU 82.A OE2 no hydrogen 2.863 N/A ILE 144.A N ASN 66.A O no hydrogen 2.888 N/A GLY 145.A N ASN 133.A O no hydrogen 2.941 N/A GLY 148.A N ASP 146.A OD2 no hydrogen 2.916 N/A THR 150.A N PHE 147.A O no hydrogen 3.220 N/A THR 150.A OG1 PHE 147.A O no hydrogen 3.497 N/A LYS 151.A N VAL 125.A O no hydrogen 2.957 N/A ILE 153.A N GLN 123.A O no hydrogen 2.824 N/A LYS 157.A N GLU 154.A O no hydrogen 3.298 N/A VAL 160.A N SER 179.A O no hydrogen 2.951 N/A LYS 161.A NZ THR 159.A O no hydrogen 3.033 N/A ARG 164.A N ASP 162.A OD1 no hydrogen 3.201 N/A SER 166.A OG ASP 163.A O no hydrogen 2.963 N/A VAL 168.A N SER 166.A O no hydrogen 2.906 N/A TRP 170.A N PRO 167.A O no hydrogen 2.967 N/A TRP 170.A NE1 GLU 196.A OE1 no hydrogen 2.904 N/A TYR 171.A N VAL 168.A O no hydrogen 3.256 N/A TYR 171.A OH ARG 127.A O no hydrogen 2.816 N/A GLU 174.A N GLU 174.A OE1 no hydrogen 2.828 N/A CYS 175.A N ALA 172.A O no hydrogen 3.034 N/A CYS 175.A SG LYS 180.A O no hydrogen 3.447 N/A CYS 175.A SG SER 185.A OG no hydrogen 3.476 N/A LEU 176.A N ALA 172.A O no hydrogen 3.264 N/A MET 177.A N PRO 173.A O no hydrogen 2.924 N/A GLN 178.A N GLU 174.A O no hydrogen 3.104 N/A SER 179.A N CYS 175.A O no hydrogen 3.179 N/A SER 179.A OG ASP 163.A OD1 no hydrogen 2.950 N/A SER 179.A OG ASP 163.A OD2 no hydrogen 2.913 N/A TYR 182.A N SER 185.A OG no hydrogen 2.978 N/A SER 185.A N TYR 182.A O no hydrogen 3.006 N/A SER 185.A OG GLU 174.A OE2 no hydrogen 2.816 N/A VAL 187.A N ILE 183.A O no hydrogen 3.157 N/A TRP 188.A N ALA 184.A O no hydrogen 3.147 N/A SER 189.A N SER 185.A O no hydrogen 3.240 N/A SER 189.A OG TRP 170.A O no hydrogen 2.842 N/A SER 189.A OG SER 185.A O no hydrogen 3.459 N/A PHE 190.A N ASP 186.A O no hydrogen 2.995 N/A GLY 191.A N VAL 187.A O no hydrogen 3.206 N/A VAL 192.A N TRP 188.A O no hydrogen 3.384 N/A THR 193.A N SER 189.A O no hydrogen 2.949 N/A THR 193.A OG1 SER 189.A O no hydrogen 3.036 N/A LEU 194.A N PHE 190.A O no hydrogen 2.776 N/A HIS 195.A N GLY 191.A O no hydrogen 3.164 N/A HIS 195.A NE2 PRO 238.A O no hydrogen 2.795 N/A GLU 196.A N VAL 192.A O no hydrogen 3.109 N/A LEU 197.A N THR 193.A O no hydrogen 2.999 N/A LEU 198.A N LEU 194.A O no hydrogen 2.995 N/A THR 199.A N HIS 195.A O no hydrogen 3.129 N/A THR 199.A OG1 HIS 195.A O no hydrogen 3.268 N/A THR 199.A OG1 GLU 196.A O no hydrogen 3.227 N/A TYR 200.A N LEU 197.A O no hydrogen 3.128 N/A TYR 200.A OH ILE 100.A O no hydrogen 2.715 N/A CYS 201.A N GLU 196.A O no hydrogen 2.830 N/A CYS 201.A SG LEU 89.A O no hydrogen 3.978 N/A CYS 201.A SG GLU 196.A O no hydrogen 3.925 N/A ASP 202.A N THR 199.A O no hydrogen 3.264 N/A SER 205.A N ASP 202.A O no hydrogen 3.231 N/A SER 205.A OG ASP 202.A OD2 no hydrogen 2.722 N/A SER 206.A N SER 203.A O no hydrogen 3.289 N/A SER 206.A OG SER 203.A O no hydrogen 3.240 N/A ALA 209.A N SER 206.A OG no hydrogen 3.108 N/A LEU 210.A N SER 206.A O no hydrogen 2.987 N/A PHE 211.A N PRO 207.A O no hydrogen 3.009 N/A LEU 212.A N MET 208.A O no hydrogen 3.112 N/A LYS 213.A N ALA 209.A O no hydrogen 3.357 N/A MET 214.A N LEU 210.A O no hydrogen 3.238 N/A ILE 215.A N PHE 211.A O no hydrogen 2.945 N/A GLY 216.A N LEU 212.A O no hydrogen 2.782 N/A MET 222.A N HIS 219.A O no hydrogen 2.945 N/A THR 223.A N GLY 220.A O no hydrogen 3.289 N/A THR 223.A OG1 GLY 220.A O no hydrogen 2.696 N/A ARG 226.A N MET 222.A O no hydrogen 2.902 N/A LEU 227.A N THR 223.A O no hydrogen 2.821 N/A VAL 228.A N VAL 224.A O no hydrogen 2.890 N/A ASN 229.A N THR 225.A O no hydrogen 3.038 N/A THR 230.A N ARG 226.A O no hydrogen 2.998 N/A LEU 231.A N LEU 227.A O no hydrogen 3.160 N/A LYS 232.A N VAL 228.A O no hydrogen 2.972 N/A GLU 233.A N ASN 229.A O no hydrogen 3.091 N/A GLY 234.A N LEU 231.A O no hydrogen 3.045 N/A LYS 235.A N THR 230.A O no hydrogen 3.119 N/A ARG 236.A NE TRP 253.A O no hydrogen 2.918 N/A ARG 236.A NH1 LEU 231.A O no hydrogen 2.863 N/A ARG 236.A NH1 LYS 235.A O no hydrogen 2.868 N/A ARG 236.A NH2 TRP 253.A O no hydrogen 3.060 N/A CYS 239.A SG PRO 240.A O no hydrogen 3.747 N/A VAL 245.A N PRO 242.A O no hydrogen 2.798 N/A TYR 246.A N PRO 242.A O no hydrogen 3.157 N/A TYR 246.A OH LEU 237.A O no hydrogen 2.803 N/A GLN 247.A N ASP 243.A O no hydrogen 3.161 N/A GLN 247.A NE2 ASP 243.A O no hydrogen 3.489 N/A MET 249.A N VAL 245.A O no hydrogen 3.066 N/A ARG 250.A N TYR 246.A O no hydrogen 2.859 N/A ARG 250.A NH1 TYR 246.A OH no hydrogen 2.937 N/A LYS 251.A N GLN 247.A O no hydrogen 3.187 N/A CYS 252.A N MET 249.A O no hydrogen 3.058 N/A CYS 252.A SG LEU 248.A O no hydrogen 3.564 N/A TRP 253.A N ARG 250.A O no hydrogen 3.049 N/A ASN 259.A N GLN 256.A O no hydrogen 3.042 N/A ARG 260.A N PRO 257.A O no hydrogen 3.225 N/A ARG 260.A NE GLU 254.A O no hydrogen 2.869 N/A ARG 260.A NH1 GLU 174.A OE2 no hydrogen 2.806 N/A ARG 260.A NH1 ALA 184.A O no hydrogen 3.030 N/A ARG 260.A NH2 GLU 174.A OE1 no hydrogen 2.799 N/A ARG 260.A NH2 GLU 174.A OE2 no hydrogen 3.528 N/A ARG 260.A NH2 GLU 254.A O no hydrogen 3.448 N/A ARG 260.A NH2 PHE 255.A O no hydrogen 3.156 N/A THR 261.A OG1 SER 262.A O no hydrogen 3.196 N/A THR 261.A OG1 ASN 265.A OD1 no hydrogen 2.834 N/A ASN 265.A N SER 262.A OG no hydrogen 3.302 N/A LEU 266.A N SER 262.A O no hydrogen 3.136 N/A ILE 267.A N PHE 263.A O no hydrogen 3.000 N/A GLU 268.A N GLN 264.A O no hydrogen 3.186 N/A GLY 269.A N ASN 265.A O no hydrogen 3.077 N/A PHE 270.A N LEU 266.A O no hydrogen 2.863 N/A GLU 271.A N ILE 267.A O no hydrogen 2.900 N/A ALA 272.A N GLU 268.A O no hydrogen 3.045 N/A LEU 273.A N PHE 270.A O no hydrogen 3.177 N/A LEU 274.A N GLU 271.A O no hydrogen 3.207 N/A LYS 275.A N GLU 271.A O no hydrogen 3.317 N/A